N-(2-methyl-4-morpholin-4-yl-phenyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(2-methyl-4-morpholin-4-yl-phenyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-(2-methyl-4-morpholino-phenyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-methyl-4-(4-morpholinyl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(2-methyl-4-morpholin-4-ylphenyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(2-methyl-4-morpholino-phenyl)propionamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C22H24N4O3S/c1-15-14-16(25-10-12-29-13-11-25)6-7-18(15)23-20(27)8-9-26-21(28)17-4-2-3-5-19(17)24-22(26)30/h2-7,14H,8-13H2,1H3,(H,23,27)(H,24,30)